Vitas-M small molecule compound

ethyl 1-(3-bromophenyl)-5-hydroxy-2-methyl-1H-indole-3-carboxylate

Catalog ID
STK869607
SMILES CCOC(=O)c1c(C)n(c2c1cc(O)cc2)c1cccc(c1)Br

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H16BrNO3 MW 374.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO3/c1-3-23-18(22)17-11(2)20(13-6-4-5-12(19)9-13)16-8-7-14(21)10-15(16)17/h4-10,21H,3H2,1-2H3
InChIKey
PLQURVBPCLDAKR-UHFFFAOYSA-N
Synonyms
306957-43-7
306957437
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C3=CC(=CC=C3)Br)C
ethyl1(3bromophenyl)5hydroxy2methyl1Hindole3carboxylate
ETHYL1(3BROMOPHENYL)5HYDROXY2METHYLINDOLE3CARBOXYLATE
InChI=1SC18H16BrNO3c132318(22)1711(2)20(1364512(19)913)168714(21)1015(16)17h41021H3H212H3
MFCD01168849
ZINC000000835754
ZINC00835754
ZINC835754

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.